Compound Identification
SMILES
OC(=O)CC(NC(=O)C1CN(C(=O)C1)C1=CC(NC(=O)NCC2=CC=CS2)=CC=C1)C1=CC(Cl)=CC(Cl)=C1O
InChIKey
InChIKey=APKRRSMPIKRMJP-UHFFFAOYSA-N
Formula
C26H24Cl2N4O6S
Mass
591.46
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrrolidines
- Subclass Phenylpyrrolidines
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Class
Pyrrolidines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolidines
Subclass
Phenylpyrrolidines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrrolidines
Alternative Parents
Beta amino acids and derivatives Phenylpropanoic acids N-phenylureas Dichlorobenzenes Pyrrolidinecarboxamides O-chlorophenols P-chlorophenols Aryl chlorides Pyrrolidine-2-ones Thiophenes Tertiary carboxylic acid amides Heteroaromatic compounds Pyrroles Secondary carboxylic acid amides Lactams Ureas Monocarboxylic acids and derivatives Azacyclic compounds Carboxylic acids Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Beta amino acid or derivatives - 3-phenylpropanoic-acid - 1-phenylpyrrolidine - N-phenylurea - 2-chlorophenol - 2-halophenol - 4-halophenol - 4-chlorophenol - 1,3-dichlorobenzene - Pyrrolidine carboxylic acid or derivatives - Pyrrolidine-3-carboxamide - Chlorobenzene - Phenol - Halobenzene - Benzenoid - Aryl halide - Aryl chloride - Monocyclic benzene moiety - Pyrrolidone - 2-pyrrolidone - Tertiary carboxylic acid amide - Pyrrole - Thiophene - Heteroaromatic compound - Carboxamide group - Urea - Secondary carboxylic acid amide - Lactam - Azacycle - Carboxylic acid - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - Organohalogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrrolidines. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrolidine ring through a CC or CN bond. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
External Descriptors
Not available